-
Name
(3Z)-3-(3-chloro-10,11-dihydro-5H-dibenzo[a,d][7]annulen-5-ylidene)-N,N-dimethylpropan-1-aminium chloride
- EINECS
- CAS No. 2047-30-5
- Density g/cm3
- Solubility
- Melting Point
- Formula C20H22ClN•ClH
- Boiling Point 423.1°Cat760mmHg
- Molecular Weight 348.34
- Flash Point 209.7°C
- Transport Information
- Appearance
- Safety Poison by ingestion and intravenous routes. When heated to decomposition it emits very toxic fumes of Cl− and NOx.
- Risk Codes
-
Molecular Structure
- Hazard Symbols
- Synonyms
- PSA
- LogP
Chlorproheptadiene hydrochloride Chemical Properties
Following is the structure of Chlorproheptadiene hydrochloride (CAS NO.2047-30-5):
Empirical Formula: C20H23Cl2N
Molecular Weight: 348.3093 g/mol
Flash Point: 209.7 °C
Enthalpy of Vaporization: 67.74 kJ/mol
Boiling Point: 423.1 °C at 760 mmHg
Vapour Pressure of Chlorproheptadiene hydrochloride (CAS NO.2047-30-5): 2.3E-07 mmHg at 25 °C
Canonical SMILES: C[NH+](C)CCC=C1C2=CC=CC=C2CCC3=C1C=C(C=C3)Cl.[Cl-]
Isomeric SMILES: C[NH+](C)CC/C=C\1/C2=CC=CC=C2CCC3=C1C=C(C=C3)Cl.[Cl-]
InChI: InChI=1S/C20H22ClN.ClH/c1-22(2)13-5-8-19-18-7-4-3-6-15(18)9-10-16-11-12-17(21)14-20(16)19;/h3-4,6-8,11-12,14H,5,9-10,13H2,1-2H3;1H/b19-8-;
InChIKey: IBVBFSLPVBAYSV-SRJUEMFDSA-N
Chlorproheptadiene hydrochloride Toxicity Data With Reference
| 1. | orl-mus LD50:210 mg/kg | AIPTAK Archives Internationales de Pharmacodynamie et de Therapie. 144 (1963),481. | ||
| 2. | ivn-mus LD50:43 mg/kg | AIPTAK Archives Internationales de Pharmacodynamie et de Therapie. 144 (1963),481. |
Chlorproheptadiene hydrochloride Safety Profile
Poison by ingestion and intravenous routes. When heated to decomposition, Chlorproheptadiene hydrochloride (CAS NO.2047-30-5) emits very toxic fumes of Cl− and NOx.
Chlorproheptadiene hydrochloride Specification
Chlorproheptadiene hydrochloride , its cas register number is 2047-30-5. It also can be called Chloroamitriptyline hydrochloride ; and Chlorproheptadien . Its classification code is Drug / Therapeutic Agent.
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